Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.43 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.43 |
| ▸ | PRKDC | P78527 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | SCN7A | Q01118 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8949298 | 0.87 | KDM4E (0.47) | TSHRKDM4EHSD17B10POLBCYP3A4 | |
| SCHEMBL9260471 | 0.80 | CNR2 (0.41) | POLBHPGDEGLN1 | |
| SCHEMBL28300713 | 0.76 | MEN1 (0.51) | KDM4EHSD17B10POLBALDH1A1SMN1; SMN2 | |
| SCHEMBL8949294 | 0.76 | CNR1 (0.46) | POLBSMN1; SMN2GAAMEN1KMT2A | |
| SCHEMBL29784613 | 0.75 | TSHR (0.59) | TSHRKDM4EHSD17B10POLBCYP3A4 | |
| SCHEMBL23909112 | 0.73 | S1PR2 (0.45) | ALDH1A1SCN7AKCNH2TP53GAA | |
| SCHEMBL7275259 | 0.72 | PHGDH (0.48) | KDM4EALDH1A1GAAHPGDMEN1 | |
| SCHEMBL8949199 | 0.69 | ITGB3 (0.43) | TSHRKDM4EHSD17B10POLBCYP3A4 | |
| SCHEMBL9571672 | 0.68 | ITGB3 (0.38) | TSHRKDM4EHSD17B10POLBCYP3A4 | |
| SCHEMBL23915287 | 0.67 | S1PR2 (0.45) | KDM4EPOLBALDH1A1SCN7AKCNH2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5563268-A | FOR PREVENTING CELL AGGLOMERATION, TREATING THROMBOSIS, ARTERIOSCLEROSIS, BRAIN, LUNG OR CARDIOVASCULAR DISORDERS | DR. KARL THOMAE GMBH (DE) | 1996-10-08 | — | — | US | disclosed |
| US-5418233-A | FOR INHIBITING CELL AGGREGATION | KARL THOMAE GMBH (DE) | 1995-05-23 | — | — | US | disclosed |
| EP-0537696-A1 | Heterobiaryl derivatives, medicines containing those compounds and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1993-04-21 | — | — | EP | disclosed |